SCHEMBL13613820

SCHEMBL13613820

CCC(COCCC1CCN(C(=O)Nc2cccc(C(C)=O)c2)CC1)n1cnc2c(N)nc3ccccc3c21

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
MAPT P10636 2/20 0.39
ADRB3 P13945 1/20 0.38
FAAH O00519 5/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CCR2 P41597 1/20 0.36
IDO1 P14902 1/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 2/20 0.36
POLB P06746 1/20 0.35
TLR7 Q9NYK1 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13613812 0.93 FAAH (0.42) LMNAMAPTFAAHMEN1KMT2A
SCHEMBL13613817 0.91 CCR3 (0.44) FAAHNPC1RAB9A
SCHEMBL13613822 0.91 CCR2 (0.40) LMNAMAPTFAAHCCR2IDO1
SCHEMBL13613816 0.90 CYP2D6 (0.37) FAAHCCR2
SCHEMBL13613810 0.86 TLR7 (0.39) LMNAMEN1KMT2APOLBTLR7
SCHEMBL13613827 0.85 KMT2A (0.38) LMNAMAPTMEN1KMT2APOLB
SCHEMBL13613824 0.84 TAS1R3 (0.40) LMNAMAPTMEN1KMT2ANPC1
SCHEMBL13613811 0.84 TLR7 (0.39) LMNAMEN1KMT2APOLBTLR7
SCHEMBL13613815 0.84 LCK (0.36) LMNAMAPTPOLBTLR7
SCHEMBL13613819 0.82 EPHX2 (0.41)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612083-B2 Urea substituted imidazoquinoline ethers COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-11-03 US disclosed
US-7612083-B2 Urea substituted imidazoquinoline ethers COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-11-03 US disclosed
US-7214675-B2 Urea substituted imidazoquinoline ethers 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-08 US disclosed
US-7214675-B2 Urea substituted imidazoquinoline ethers 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-08 US disclosed